ChemSpider 2D Image | N-Carbamoyl-D-isoleucine | C7H14N2O3

N-Carbamoyl-D-isoleucine

  • Molecular FormulaC7H14N2O3
  • Average mass174.198 Da
  • Monoisotopic mass174.100449 Da
  • ChemSpider ID67491468

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

D-Isoleucine, N-(aminocarbonyl)- [ACD/Index Name]
N-Carbamoyl-D-isoleucin [German] [ACD/IUPAC Name]
N-Carbamoyl-D-isoleucine [ACD/IUPAC Name]
N-Carbamoyl-D-isoleucine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 321.9±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 62.0±6.0 kJ/mol
Flash Point: 148.5±25.7 °C
Index of Refraction: 1.490
Molar Refractivity: 43.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.17
ACD/LogD (pH 5.5): -1.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 17.1±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 149.1±3.0 cm3

Click to predict properties on the Chemicalize site


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